![3-{2,2-Bis[4-(dimethylamino)phenyl]-2-hydroxyethyl}benzonitrile structure](/static/products/5948/59483-76-0.webp)
3-{2,2-Bis[4-(dimethylamino)phenyl]-2-hydroxyethyl}benzonitrile
TL;DR: 3-{2,2-Bis[4-(dimethylamino)phenyl]-2-hydroxyethyl}benzonitrile (CAS 59483-76-0) is a chemical compound with molecular formula C25H27N3O and molecular weight 385.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2,2-bis[4-(dimethylamino)phenyl]-2-hydroxyethyl]benzonitrile
Also Known As: 3-{2,2-Bis[4-(dimethylamino)phenyl]-2-hydroxyethyl}benzonitrile, 3-[2,2-bis(4-dimethylaminophenyl)-2-hydroxyethyl]benzonitrile, 3-[2,2-bis[4-(dimethylamino)phenyl]-2-hydroxyethyl]benzonitr
| Molecular Formula | C25H27N3O |
|---|---|
| Molecular Weight | 385.22 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 50.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 385.21542 |
| Heavy Atoms | 29 |
| Complexity | 522.0 |
Chemical Identifiers
| CAS Number | 59483-76-0 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)C(CC2=CC(=CC=C2)C#N)(C3=CC=C(C=C3)N(C)C)O |
| InChIKey | LGXJQCHAIPIHIN-UHFFFAOYSA-N |
Product Overview
3-{2,2-Bis[4-(dimethylamino)phenyl]-2-hydroxyethyl}benzonitrile (CAS 59483-76-0), with molecular formula C25H27N3O and molecular weight 385.22 g/mol. IUPAC: 3-[2,2-bis[4-(dimethylamino)phenyl]-2-hydroxyethyl]benzonitrile.
Chemical Property Profile of 3-{2,2-Bis[4-(dimethylamino)phenyl]-2-hydroxyethyl}benzonitrile
Property Insights of 3-{2,2-Bis[4-(dimethylamino)phenyl]-2-hydroxyethyl}benzonitrile
The XLogP value of 4.5 indicates that 3-{2,2-Bis[4-(dimethylamino)phenyl]-2-hydroxyethyl}benzonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.5 Ų, 3-{2,2-Bis[4-(dimethylamino)phenyl]-2-hydroxyethyl}benzonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-{2,2-Bis[4-(dimethylamino)phenyl]-2-hydroxyethyl}benzonitrile has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-{2,2-Bis[4-(dimethylamino)phenyl]-2-hydroxyethyl}benzonitrile?
The CAS number of 3-{2,2-Bis[4-(dimethylamino)phenyl]-2-hydroxyethyl}benzonitrile is 59483-76-0.
What is the molecular formula of 3-{2,2-Bis[4-(dimethylamino)phenyl]-2-hydroxyethyl}benzonitrile?
The molecular formula of 3-{2,2-Bis[4-(dimethylamino)phenyl]-2-hydroxyethyl}benzonitrile is C25H27N3O.
What is the molecular weight of 3-{2,2-Bis[4-(dimethylamino)phenyl]-2-hydroxyethyl}benzonitrile?
The molecular weight of 3-{2,2-Bis[4-(dimethylamino)phenyl]-2-hydroxyethyl}benzonitrile is 385.22 g/mol.
Where can I buy 3-{2,2-Bis[4-(dimethylamino)phenyl]-2-hydroxyethyl}benzonitrile?
You can request a quote for 3-{2,2-Bis[4-(dimethylamino)phenyl]-2-hydroxyethyl}benzonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-{2,2-Bis[4-(dimethylamino)phenyl]-2-hydroxyethyl}benzonitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-{2,2-Bis[4-(dimethylamino)phenyl]-2-hydroxyethyl}benzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.